# New ports collection makefile for: gromacs # Date created: August 28 2004 # Whom: Stephen Montgomery-Smith # # $FreeBSD$ # PORTNAME= gromacs PORTVERSION= 3.2.1 CATEGORIES= science MASTER_SITES= ftp://ftp.gromacs.org/pub/gromacs/ MAINTAINER= stephen@math.missouri.edu COMMENT= Compute molecular dynamics .ifndef WITHOUT_FFTW LIB_DEPENDS= fftw:${PORTSDIR}/math/fftw:install .endif .ifdef WITH_MPI BUILD_DEPENDS= ${LOCALPREFIX}/mpich/bin/mpicc:${PORTSDIR}/net/mpich:install RUN_DEPENDS= ${LOCALPREFIX}/mpich/bin/mpicc:${PORTSDIR}/net/mpich:install .endif USE_GMAKE= yes GNU_CONFIGURE= yes CONFIGURE_TARGET= --build=${MACHINE_ARCH}-portbld-freebsd${OSREL} CONFIGURE_ENV= CPPFLAGS=-I${LOCALBASE}/include LDFLAGS=-L${LOCALBASE}/lib CONFIGURE_ARGS= --exec-prefix=${PREFIX} PLIST_SUB= BUILD=${MACHINE_ARCH}-portbld-freebsd${OSREL} .ifndef WITHOUT_FFTW .ifdef WITH_FLOAT IGNORE= Cannot currently build with fftw and single precision floating point .elifdef WITH_MPI IGNORE= Cannot currently build with fftw and mpi support .endif .endif .ifdef WITHOUT_X PLIST_SUB+= WITHOUT_X="@comment " CONFIGURE_ARGS+= --without-x .else PLIST_SUB+= WITHOUT_X= CONFIGURE_ARGS+= --with-x USE_XLIB= yes .endif .ifdef WITHOUT_FFTW CONFIGURE_ARGS+= --without-fftw .endif .ifdef WITH_MPI CONFIGURE_ARGS+= --enable-mpi CONFIGURE_ENV+= MPICC=${PREFIX}/mpich/bin/mpicc PLIST_SUB+= WITH_MPI= _MPI=_mpi .else PLIST_SUB+= WITH_MPI="@comment " SUFFIX_MPI= .endif MAN1= anadock.1 \ g_cluster.1 \ g_filter.1 \ g_potential.1 \ g_velacc.1 \ ngmx.1 \ cdist.1 \ g_clustsize.1 \ g_gyrate.1 \ g_rama.1 \ g_wham.1 \ pdb2gmx.1 \ disco.1 \ g_confrms.1 \ g_h2order.1 \ g_rdf.1 \ genbox.1 \ protonate.1 \ do_dssp.1 \ g_covar.1 \ g_hbond.1 \ g_rms.1 \ genconf.1 \ tpbconv.1 \ editconf.1 \ g_density.1 \ g_helix.1 \ g_rmsdist.1 \ genion.1 \ trjcat.1 \ eneconv.1 \ g_dielectric.1 \ g_lie.1 \ g_rmsf.1 \ genpr.1 \ trjconv.1 \ ffscan.1 \ g_dih.1 \ g_mdmat.1 \ g_rotacf.1 \ gmxcheck.1 \ trjorder.1 \ g_anaeig.1 \ g_dipoles.1 \ g_mindist.1 \ g_saltbr.1 \ gmxdump.1 \ wheel.1 \ g_analyze.1 \ g_disre.1 \ g_morph.1 \ g_sas.1 \ grompp.1 \ x2top.1 \ g_angle.1 \ g_dist.1 \ g_msd.1 \ g_sgangle.1 \ highway.1 \ xpm2ps.1 \ g_bond.1 \ g_dyndom.1 \ g_nmeig.1 \ g_sorient.1 \ make_ndx.1 \ xrama.1 \ g_bundle.1 \ g_enemat.1 \ g_nmens.1 \ g_tcaf.1 \ mdrun.1 \ g_chi.1 \ g_energy.1 \ g_order.1 \ g_traj.1 \ mk_angndx.1 .include pre-fetch: @${ECHO} @${ECHO} "OPTIONS:" @${ECHO} @${ECHO} "To compile without X11: define WITHOUT_X" @${ECHO} "To compile using single precision floating point: define WITH_FLOAT" @${ECHO} "To compile without fftw: define WITHOUT_FFTW" @${ECHO} "To compile with mpi: define WITH_MPI" @${ECHO} .include _and_yarn/devel/electron4/files/serve-10.1.2'>dependabot/npm_and_yarn/devel/electron4/files/serve-10.1.2 FreeBSD GNOME current development ports (https://github.com/freebsd/freebsd-ports-gnome)
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